SCHEMBL28435916

SCHEMBL28435916

Cc1c(C2CCCCC2)c(F)c(F)c(-c2ccccc2)c1C1CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ MAT2A P31153 4/20 0.36
▸ RAB9A P51151 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ PSMB8 P28062 1/20 0.34
▸ PSMB5 P28074 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ CASP3 P42574 1/20 0.34
▸ SENP7 Q9BQF6 1/20 0.34
▸ SENP6 Q9GZR1 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ NPY5R Q15761 1/20 0.33
▸ PTGS2 P35354 1/20 0.32
▸ KCNA3 P22001 1/20 0.31
▸ ADORA1 P30542 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28435918 1.00 ABCB1 (0.37) ABCB1HPGDMAT2ARAB9AMEN1
SCHEMBL29214526 0.80 MEN1 (0.34) ABCB1HPGDMAT2ARAB9AMEN1
SCHEMBL31403438 0.75 MEN1 (0.34) ABCB1HPGDMAT2ARAB9AMEN1
SCHEMBL31403442 0.72 DRD2 (0.35) ABCB1HPGDMAT2ARAB9AMEN1
SCHEMBL1408109 0.72 HPGD (0.44) HPGDMAT2ARAB9AMEN1MAPT
SCHEMBL31186270 0.71 ADORA3 (0.33) HPGDRAB9AMEN1MAPTKMT2A
SCHEMBL9779733 0.70 PTGS2 (0.40) ABCB1HPGDMAT2AMEN1MAPT
SCHEMBL3497365 0.69 KDM4E (0.38) RAB9AMEN1MAPTKMT2AL3MBTL1
SCHEMBL12815311 0.68 HPGD (0.35) HPGDMAT2ARAB9AMEN1MAPT
Phosphine SCHEMBL5609398 0.68 MEN1 (0.36) HPGDMAT2ARAB9AMEN1MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111440053-A Industrial production method of cyclopropylmethyl cyclohexyl difluorobiphenyl compounds 西安瑞联新材料股份有限公司 2020-07-24 — — CN claimed
CN-111440053-A Industrial production method of cyclopropylmethyl cyclohexyl difluorobiphenyl compounds 西安瑞联新材料股份有限公司 2020-07-24 — — CN disclosed
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